SCHEMBL20185049

SCHEMBL20185049

NC1CCC2(CC1)CCN(c1ccccc1Cl)C2=O.NC1CCC2(CC1)CCN(c1ccccc1Cl)C2=O

nearest known ligand 0.51

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 3/20 0.51
EGLN1 Q9GZT9 1/20 0.39
LIPE Q05469 1/20 0.39
NOTUM Q6P988 1/20 0.38
ALOX5 P09917 2/20 0.37
HDAC1 Q13547 1/20 0.36
HDAC8 Q9BY41 1/20 0.36
HDAC6 Q9UBN7 1/20 0.36
MGLL Q99685 1/20 0.36
P2RX7 Q99572 1/20 0.36
OPRM1 P35372 1/20 0.35
KCNH2 Q12809 1/20 0.35
SIGMAR1 Q99720 1/20 0.35
ALDH1A1 P00352 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
HTR7 P34969 1/20 0.35
MAPK14 Q16539 1/20 0.35

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL18208964 1.00 HSD11B1 (0.51) HSD11B1EGLN1LIPENOTUMALOX5
SCHEMBL18208689 0.86 HSD11B1 (0.51) HSD11B1EGLN1LIPENOTUMALOX5
SCHEMBL20103479 0.84 HSD11B1 (0.51) HSD11B1EGLN1LIPEALOX5ALDH1A1
SCHEMBL18208900 0.82 CYP17A1 (0.39) HSD11B1EGLN1
SCHEMBL18208520 0.81 P2RX7 (0.44) P2RX7
SCHEMBL18208519 0.81 P2RX7 (0.44) P2RX7
SCHEMBL18208450 0.79 FFAR4 (0.45) HSD11B1OPRM1
SCHEMBL18208919 0.79 HSD11B1 (0.46) HSD11B1EGLN1LIPENOTUMALOX5
SCHEMBL18208793 0.79 EGLN1 (0.45) HSD11B1EGLN1
SCHEMBL18208803 0.78 HSD11B1 (0.45) HSD11B1EGLN1LIPENOTUMOPRM1

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES BAYER PHARMA AKTIENGESELLSCHAFT (DE) 2018-05-31 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20180148418-A1 AMIDO-SUBSTITUTED CYCLOHEXANE DERIVATIVES C1R, C9, C1S HSD11B1 1812/4885EGLN1 265/4885LIPE 3110/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.